SCHEMBL15420495

SCHEMBL15420495

CCS(=O)(=O)N[C@H]1CCOC[C@@H]1COc1ccc(-c2ccc(F)cn2)c(F)c1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 3/20 0.37
GRIA2 P42262 1/20 0.35
SMO Q99835 1/20 0.34
GRM2 Q14416 1/20 0.34
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
FFAR1 O14842 1/20 0.33
CYP2C8 P10632 1/20 0.33
MAPK14 Q16539 3/20 0.33
GRM4 Q14833 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
PIK3R1 P27986 1/20 0.32
PIK3CA P42336 1/20 0.32
DGAT1 O75907 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
NTRK1 P04629 1/20 0.32
AXL P30530 1/20 0.32
MERTK Q12866 1/20 0.32
SCN9A Q15858 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12988572 1.00 GRM5 (0.37) GRM5GRIA2SMOGRM2ALOX5AP
SCHEMBL12988224 1.00 GRM5 (0.37) GRM5GRIA2SMOGRM2ALOX5AP
SCHEMBL12987497 0.92 SMO (0.40) GRM5GRIA2SMOGRM2ALOX5AP
SCHEMBL12987435 0.92 SMO (0.40) GRM5GRIA2SMOGRM2ALOX5AP
SCHEMBL12987370 0.92 SMO (0.40) GRM5GRIA2SMOGRM2ALOX5AP
SCHEMBL15441494 0.91 SMO (0.34) GRM5SMOGRM2ALOX5APFEN1
SCHEMBL15419974 0.91 SMO (0.34) GRM5SMOGRM2ALOX5APFEN1
SCHEMBL15441453 0.90 GRM5 (0.35) GRM5GRIA2SMOGRM2ALOX5AP
SCHEMBL12987272 0.90 GRM5 (0.35) GRM5GRIA2SMOGRM2ALOX5AP
SCHEMBL15441034 0.87 GRIA2 (0.46) GRM5GRIA2GRM4DGAT1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2694472-B1 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2020-03-11 EP disclosed
US-9527807-B2 Sulfonamide derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-12-27 US disclosed
US-9527807-B2 Sulfonamide derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-12-27 US disclosed
US-9527807-B2 Sulfonamide derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-12-27 US disclosed
US-20140024650-A1 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-01-23 US disclosed
US-20140024650-A1 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-01-23 US disclosed
US-20140024650-A1 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-01-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140024650-A1 SULFONAMIDE DERIVATIVE AND USE THEREOF GRIN2A, GRIN2B, SLC1A2 GRM5 9/4885GRIA2 12/4885SMO 244/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.